Quantum dynamics of inelastic scattering with a moving grid.
- Published in:
- International Journal of Quantum Chemistry, 2005, v. 105, n. 3, p. 209, doi. 10.1002/qua.20666
- By:
- Publication type:
- Article
Works matching IS 00207608 AND DT 2005 AND VI 105 AND IP 3
Results: 9
1
2
Localized molecular orbitals in the Hückel model of perturbed alternant hydrocarbons and their relation to the charge–bond order matrix.
- Published in:
- International Journal of Quantum Chemistry, 2005, v. 105, n. 3, p. 232, doi. 10.1002/qua.20689
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- Publication type:
- Article
3
Ab initio study of molecular oxygen adsorption on Pu (111) surface.
- Published in:
- International Journal of Quantum Chemistry, 2005, v. 105, n. 3, p. 280, doi. 10.1002/qua.20701
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- Publication type:
- Article
4
Computation of quantum mechanical hybridization and dipole correlation of the electronic structure of the F<sub>3</sub>B–NH<sub>3</sub> supermolecule.
- Published in:
- International Journal of Quantum Chemistry, 2005, v. 105, n. 3, p. 270, doi. 10.1002/qua.20690
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- Publication type:
- Article
5
Construction and utilisation of planar graphs of two series of IPR fullerenes through the use of threefold rotational symmetry.
- Published in:
- International Journal of Quantum Chemistry, 2005, v. 105, n. 3, p. 201, doi. 10.1002/qua.20693
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- Publication type:
- Article
6
The first and second derivative matrices in the random phase approximation scheme by using the Lagrangian technique.
- Published in:
- International Journal of Quantum Chemistry, 2005, v. 105, n. 3, p. 225, doi. 10.1002/qua.20695
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- Publication type:
- Article
7
DFT conformational studies of the HI-6 molecule.
- Published in:
- International Journal of Quantum Chemistry, 2005, v. 105, n. 3, p. 260, doi. 10.1002/qua.20700
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- Publication type:
- Article
8
Ab initio calculation of the interaction energy in the P2 binding pocket of HIV-1 protease.
- Published in:
- International Journal of Quantum Chemistry, 2005, v. 105, n. 3, p. 292, doi. 10.1002/qua.20724
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- Publication type:
- Article
9
Electronic Fock spaces: Phase prefactors and new algebraic structure.
- Published in:
- International Journal of Quantum Chemistry, 2005, v. 105, n. 3, p. 246, doi. 10.1002/qua.20731
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- Publication type:
- Article